5-azanyl-1-(6-chloranyl-2-methylsulfanyl-pyrimidin-4-yl)pyrazole-4-carbonitrile

Systemtic Name: 5-azanyl-1-(6-chloranyl-2-methylsulfanyl-pyrimidin-4-yl)pyrazole-4-carbonitrile Openeye Name: 5-amino-1-(6-chloro-2-methylsulfanyl-pyrimidin-4-yl)pyrazole-4-carbonitrile CAS Name: 5-amino-1-[6-chloro-2-(methylthio)-4-pyrimidinyl]-4-pyrazolecarbonitrile IUPAC Name: 5-amino-1-(6-chloro-2-methylsulfanylpyrimidin-4-yl)pyrazole-4-carbonitrile Traditional Name: 5-amino-1-[6-chloro-2-(methylthio)pyrimidin-4-yl]pyrazole-4-carbonitrile Formula: C9H7ClN6S MolecularWeight: 266.71008

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=CC(=N1)Cl)N2C(=C(C=N2)C#N)N

Isomeric SMILES

CSC1=NC(=CC(=N1)Cl)N2C(=C(C=N2)C#N)N

InChI

InChI=1S/C9H7ClN6S/c1-17-9-14-6(10)2-7(15-9)16-8(12)5(3-11)4-13-16/h2,4H,12H2,1H3